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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Delta-type opioid receptor' and Ligand = 'BDBM50376838'   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kJ/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))		BDBM50376838
PNG
(CHEMBL260809)
Show SMILES COC(=O)[C@@H]1C[C@H](OC(=O)c2cccc(c2)[N+]([O-])=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1
Show InChI InChI=1S/C28H29NO10/c1-27-9-7-18-26(33)39-21(16-8-10-37-14-16)13-28(18,2)23(27)22(30)20(12-19(27)25(32)36-3)38-24(31)15-5-4-6-17(11-15)29(34)35/h4-6,8,10-11,14,18-21,23H,7,9,12-13H2,1-3H3/t18-,19-,20-,21-,23-,27-,28-/m0/s1
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Similars
Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



The University of Iowa

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells

J Med Chem 51: 2421-31 (2008)


Article DOI: 10.1021/jm701162g
BindingDB Entry DOI: 10.7270/Q2DV1KR7
More data for this
Ligand-Target Pair